EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:39120 - (−)-trans-allethrin

ChEBI IDCHEBI:39120
ChEBI Name(−)-trans-allethrin
Stars
ASCII Name(-)-trans-allethrin
Last Modified9 August 2007
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC19H26O3
Net Charge0
Average Mass302.414
Monoisotopic Mass302.18819
SMILESC=CCC1=C(C)C(OC(=O)[C@H]2[C@H](C=C(C)C)C2(C)C)CC1=O
InChIInChI=1S/C19H26O3/c1-7-8-13-12(4)16(10-15(13)20)22-18(21)17-14(9-11(2)3)19(17,5)6/h7,9,14,16-17H,1,8,10H2,2-6H3/t14-,16?,17+/m0/s1
InChIKeyZCVAOQKBXKSDMS-DRXWIORDSA-N
Roles Classification
Biological Role:
Application:
ChEBI Ontology
Outgoing Relation(s)
(−)-trans-allethrin (CHEBI:39120) has functional parent (−)-trans-chrysanthemic acid (CHEBI:39102)
(−)-trans-allethrin (CHEBI:39120) is a trans-allethrin (CHEBI:39117)
Incoming Relation(s)
(−)-trans-(R)-allethrin (CHEBI:39121) is a (−)-trans-allethrin (CHEBI:39120)
(−)-trans-(S)-allethrin (CHEBI:39122) is a (−)-trans-allethrin (CHEBI:39120)
IUPAC Name 
2-methyl-4-oxo-3-(prop-2-en-1-yl)cyclopent-2-en-1-yl (1S,3S)-2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropanecarboxylate
Synonym  Source
3-allyl-2-methyl-4-oxocyclopent-2-en-1-yl (1S,3S)-2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropanecarboxylateIUPAC
Registry NumbersSources
Beilstein:7113139Beilstein